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(Q82228650)
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NSC74315
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
233.09866848
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
chemical formula
C₁₂H₁₅N₃S
0 references
canonical SMILES
Cc1ccc(/C(=N/NC(=N)S)C2CC2)cc1
1 reference
based on heuristic
inferred from InChI
isomeric SMILES
CC1=CC=C(C=C1)/C(=N/NC(=S)N)/C2CC2
0 references
Identifiers
InChI
InChI=1S/C12H15N3S/c1-8-2-4-9(5-3-8)11(10-6-7-10)14-15-12(13)16/h2-5,10H,6-7H2,1H3,(H3,13,15,16)/b14-11-
0 references
InChIKey
UWGWKYXCPINOBY-KAMYIIQDSA-N
0 references
CAS Registry Number
7145-42-8
0 references
PubChem CID
5799506
1 reference
matched by identifier from
InChIKey
InChIKey
UWGWKYXCPINOBY-KAMYIIQDSA-N
UniChem compound ID
64047954
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID00418227
1 reference
matched by identifier from
InChIKey
InChIKey
UWGWKYXCPINOBY-KAMYIIQDSA-N
DSSTOX compound identifier
DTXCID70369075
0 references
NSC number
74315
0 references
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